CID 16780021

6-ethoxyimidazo[2,1-b][1,3]thiazole-5-carbaldehyde

Structural Information

Molecular Formula
C8H8N2O2S
SMILES
CCOC1=C(N2C=CSC2=N1)C=O
InChI
InChI=1S/C8H8N2O2S/c1-2-12-7-6(5-11)10-3-4-13-8(10)9-7/h3-5H,2H2,1H3
InChIKey
BMPZBUUWHLTNEI-UHFFFAOYSA-N
Compound name
6-ethoxyimidazo[2,1-b][1,3]thiazole-5-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

196.03065 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.03793 138.6
[M+Na]+ 219.01987 151.6
[M-H]- 195.02337 142.4
[M+NH4]+ 214.06447 161.4
[M+K]+ 234.99381 149.4
[M+H-H2O]+ 179.02791 133.2
[M+HCOO]- 241.02885 159.5
[M+CH3COO]- 255.04450 180.5
[M+Na-2H]- 217.00532 141.5
[M]+ 196.03010 146.6
[M]- 196.03120 146.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.